SCHEMBL7873771

SCHEMBL7873771

CNC(N)=NC(=O)c1cc2cccc(OCc3ccc(CN(C)C)cc3)c2[nH]1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
MAPT P10636 3/20 0.37
GAA P10253 1/20 0.37
SRD5A2 P31213 2/20 0.35
FLT3 P36888 1/20 0.35
SRD5A1 P18405 1/20 0.35
IDO1 P14902 1/20 0.35
TNKS O95271 2/20 0.34
LSS P48449 1/20 0.34
F10 P00742 1/20 0.34
KDM4E B2RXH2 2/20 0.34
PARP1 P09874 1/20 0.34
CHUK O15111 1/20 0.33
INSR P06213 1/20 0.33
MAPK8 P45983 1/20 0.33
CAMKK2 Q96RR4 1/20 0.33
MTNR1A P48039 1/20 0.33
MTNR1B P49286 1/20 0.33
C5AR1 P21730 1/20 0.33
MEN1 O00255 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7880990 0.94 MGMT (0.38) ALDH1A1GAASRD5A2FLT3IDO1
SCHEMBL7873853 0.91 HRH3 (0.39) ALDH1A1MAPTGAASRD5A2FLT3
SCHEMBL7873721 0.90 ALDH1A1 (0.39) ALDH1A1MAPTGAASRD5A2FLT3
SCHEMBL7880204 0.89 LSS (0.36) FLT3IDO1TNKSLSSPARP1
Hydrochloric Acid SCHEMBL7877865 0.88 SRD5A2 (0.44) ALDH1A1MAPTGAASRD5A2SRD5A1
SCHEMBL7877460 0.88 MEN1 (0.38) ALDH1A1MAPTFLT3IDO1MTNR1A
SCHEMBL7879982 0.86 FLT3 (0.33) MAPTGAAFLT3IDO1MTNR1A
SCHEMBL7881388 0.86 MAPT (0.38) ALDH1A1MAPTGAAFLT3IDO1
SCHEMBL7877638 0.85 CFD (0.43) ALDH1A1MAPTGAASRD5A2FLT3
SCHEMBL7882408 0.84 GYS1 (0.36) MAPTSRD5A2FLT3IDO1HRH4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1067988-C Indoloylguanidine derivatives SUMITOMO PHARMACEUTICS K K (JP) 2001-07-04 CN disclosed
US-6248772-B1 HYPOTENSIVE AGENTS; ANTIARRHYTHMIA AGENTS; ANTIDIABETIC AGENTS; ANTIPROLIFERATIVE AGENTS SUMITOMO PHARMACEUTICALS CO., LTD. (JP) 2001-06-19 US disclosed
US-6169107-B1 USEFUL FOR THE TREATMENT AND PREVENTION OF DISEASES CAUSED BY INCREASED SODIUM/PROTON (NA.SUP.+ /H.SUP.+) EXCHANGER ACTIVITY, FOR EXAMPLE, HYPERTENSION, ARRHYTHMIA, ANGINA PECTORIS, CARDIAC HYPERTROPHY, DIABETES MELLITUS SUMITOMO PHARMACEUTICAL CO., LTD. (JP) 2001-01-02 US disclosed
CN-1136038-A Indoloylguanidine derivatives SUMITOMO PHARMACEUTICS K K (JP) 1996-11-20 CN disclosed
EP-0708091-A2 Indoloylguanidine derivatives SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1996-04-24 EP disclosed